0 B4R0.1 C=CC(=O)O HY-W243303B [0,0,0,0,0,0|2,0,1]=3 1 B4R0.1 C=CC(=O)O HY-W243303M [0,0,0,0,0,0|2,0,1]=3 2 B4R0.1 C=CC(N)=O HY-W115727E [0,0,0,0,0,0|2,0,1]=3 3 B4R0.1 CC(=O)CN HY-W004850 [0,0,0,0,0,0|0,0,2]=2 4 B4R0.1 CSC(=N)N HY-79457 [0,0,0,0,0,0|4,0,0]=4 5 B4R0.1 C[C@H](N)CO HY-Y0837 [0,0,0,0,0,0|2,0,2]=4 6 B4R0.1 C[C@H](O)CO HY-79334 [0,0,0,0,0,0|1,0,3]=4 7 B4R0.1 NNC(N)=[Se] HY-128222 [0,0,0,0,0,0|2,1,1]=4 8 B4R0.1 [13CH3][13CH2][13C](=O)O HY-B1773AS3 [0,0,0,0,0,0|2,0,1]=3 9 B4R0.1 [13CH3][13C](=O)O[Na] HY-W749209 [0,0,0,0,0,0|2,0,0]=2 10 B4R0.1 [15NH2]C[13C](=O)O HY-Y0966S5 [0,0,0,0,0,0|1,0,2]=3 11 B4R0.1 [15NH2][13CH2]C(=O)O HY-Y0966S7 [0,0,0,0,0,0|1,0,2]=3 12 B4R0.1 [15NH2][13CH2][13C](=O)O HY-Y0966S6 [0,0,0,0,0,0|1,0,2]=3 13 B3R0.1 O=CO[Na] HY-W088065 [1,0,0,0,0,0|2,0,0]=3 14 B3R0.1 O=[13CH]O[Na] HY-W088065S [1,0,0,0,0,0|2,0,0]=3 15 B3R0.1 [13CH](=O)[13CH2]O HY-W779008 [1,0,0,0,0,0|1,0,1]=3 16 B3R0.2 CC(=O)O HY-P0119A [1,0,0,0,0,0|1,0,0]=2 17 B3R0.2 CC([15NH2])=O HY-Y0946S [1,0,0,0,0,0|0,0,1]=2 18 B3R0.2 CS(C)=O HY-Y0320 [1,0,0,0,0,0|1,0,1]=3 19 B3R0.2 CS(C)=O HY-Y0320C [1,0,0,0,0,0|1,0,1]=3 20 B3R0.2 CS(C)=O HY-Y0320D [1,0,0,0,0,0|1,0,1]=3 21 B3R0.2 O=[Si](O)O HY-B0314 [1,0,0,0,0,0|2,1,0]=4 22 B3R0.2 [2H][13C](=O)O HY-W088065S1 [1,0,0,0,0,0|2,0,0]=3 23 B5R0.1 CNCC(=O)O HY-W012791 [0,1,0,0,0,0|1,0,2]=4 24 B5R0.1 C\C=C\C(C)=O HY-34748 [0,1,0,0,0,0|1,0,1]=3 25 B5R0.1 NOCC(=O)O HY-107994A [0,1,0,0,0,0|1,0,2]=4 26 B5R0.1 [15NH2]CCC(=O)O HY-N0230S1 [0,1,0,0,0,0|1,0,2]=4 27 B5R0.3 CC[PH](=O)CC HY-W094280 [0,1,0,0,0,0|2,0,1]=4 28 B5R0.4 CS(=O)(=O)O[Na] HY-W034344 [0,1,0,0,0,0|3,0,0]=4 29 B5R0.4 CSS(C)(=O)=O HY-W004461 [0,1,0,0,0,0|3,0,0]=4 30 B5R0.4 C[As](=O)(O)O[Na] HY-W714225 [0,1,0,0,0,0|3,0,0]=4 31 B5R0.5 CC(N)[13C](=O)O HY-N2362S [0,1,0,0,0,0|1,0,2]=4 32 B5R0.5 C[13C@H]([15NH2])[13C](=O)O HY-N0229S15 [0,1,0,0,0,0|1,0,2]=4 33 B5R0.5 C[C@@H](N)C(=O)O HY-41700 [0,1,0,0,0,0|1,0,2]=4 34 B5R0.5 C[C@H](N)C(N)=O HY-75326 [0,1,0,0,0,0|1,0,2]=4 35 B5R0.5 C[C@H](N)[13C](=O)O HY-N0229S1 [0,1,0,0,0,0|1,0,2]=4 36 B5R0.5 C[C@H]([15NH2])C(=O)O HY-N0229S2 [0,1,0,0,0,0|1,0,2]=4 37 B5R0.5 O=C(O)C(I)I HY-133659 [0,1,0,0,0,0|2,0,1]=4 38 B5R0.5 O=C([O-])C(=O)[O-] HY-W140731 [0,1,0,0,0,0|2,0,1]=4 39 B5R0.5 O=[13C](O)[13C](=O)O HY-Y0262S1 [0,1,0,0,0,0|2,0,1]=4 40 B5R0.5 [13CH3]C(N)C(=O)O HY-N2362S1 [0,1,0,0,0,0|1,0,2]=4 41 B5R0.5 [13CH3][13C@H](N)C(=O)O HY-N0229S9 [0,1,0,0,0,0|1,0,2]=4 42 B5R0.5 [13CH3][13C@H](N)[13C](=O)O HY-N0229S8 [0,1,0,0,0,0|1,0,2]=4 43 B5R0.5 [13CH3][13C@H](O)[13C](=O)O HY-Y0479S [0,1,0,0,0,0|2,0,1]=4 44 B5R0.5 [13CH3][13C@H]([15NH2])[13C](=O)O HY-N0229S10 [0,1,0,0,0,0|1,0,2]=4 45 B5R0.5 [13CH3][C@H](N)C(=O)O HY-N0229S6 [0,1,0,0,0,0|1,0,2]=4 46 B2R0.1 C=CO HY-Y0850L [2,0,0,0,0,0|0,0,2]=4 47 B2R0.1 C=CO HY-Y0850M [2,0,0,0,0,0|0,0,2]=4 48 B2R0.1 C=CO HY-Y0850O [2,0,0,0,0,0|0,0,2]=4 49 B2R0.1 C=CO HY-Y0850U4 [2,0,0,0,0,0|0,0,2]=4 50 B2R0.1 [15NH2]C=O HY-Y0842S3 [2,0,0,0,0,0|0,0,1]=3 51 B2R0.1 [2H]OC HY-W025916 [2,0,0,0,0,0|2,0,0]=4 52 B2R0.1 [3H]CC HY-P99179 [2,0,0,0,0,0|1,0,1]=4 53 B4R0.2 O=COO[Na] HY-ER013B [1,1,0,0,0,0|2,0,0]=4 54 B4R0.2 [Li]OOC=O HY-Y0292 [1,1,0,0,0,0|2,0,0]=4 55 B6R0.1 C[13CH2][13CH2][13C](=O)O[Na] HY-W750796 [0,2,0,0,0,0|2,0,0]=4 56 B6R0.2 CC(=O)CC(=O)O HY-112540 [0,2,0,0,0,0|1,0,1]=4 57 B6R0.3 C(C)=C(/C)C(=O)O HY-N6929 [0,2,0,0,0,0|1,0,1]=4 58 B6R0.3 CC(=O)C(=O)O[Na] HY-W015913 [0,2,0,0,0,0|1,0,1]=4 59 B6R0.3 CC(=O)C(=O)O[Na] HY-W015913R [0,2,0,0,0,0|1,0,1]=4 60 B6R0.3 CC(=O)[13C](=O)O[Na] HY-Y0781S3 [0,2,0,0,0,0|1,0,1]=4 61 B6R0.3 CCC(=O)C(C)=O HY-W012998R [0,2,0,0,0,0|1,0,1]=4 62 B6R0.3 C[13C](=O)C(=O)O[Na] HY-Y0781S [0,2,0,0,0,0|1,0,1]=4 63 B6R0.3 C[C@H](O)[13C](=O)O[Na] HY-Y0479AS2 [0,2,0,0,0,0|2,0,0]=4 64 B6R0.3 O=C(O)C(=O)CO HY-113013 [0,2,0,0,0,0|1,0,1]=4 65 B6R0.4 C#CCCC(=O)O HY-Y1230 [0,2,0,0,0,0|2,0,0]=4